1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate: Product Overview and Commentary

What is 1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate?

1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate belongs in the world of ionic liquids. Its formula, C20H39F6N2P, merges an imidazolium cation with a hexafluorophosphate anion. For chemists who work with extraction, electrochemistry, or catalysis, this compound stands out for its distinct molecular makeup and versatility. From a visual and tactile angle, common forms include solid flakes, crystalline powder, hard pearls, and sometimes a viscous liquid, each offering possibilities for different applications and processing techniques. Scientists dealing with raw materials in the chemical industry notice this substance for its unusual structure—stacked with a lengthy hexadecyl side chain, the cation renders enhanced hydrophobicity compared to shorter homologs.

Physical and Chemical Properties

Whether in the lab or in manufacturing, the properties of 1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate catch attention. A distinct crystalline texture becomes visible at room temperature. In warmer surroundings, it may soften, transitioning into semi-solid or liquid depending on moisture content and purity. The material carries a white to off-white color, with a density typically falling near 1.07-1.09 g/cm³. Its melting point lands around 40-60°C, though small batches may vary based on ambient moisture or impurities—a factor many researchers must verify before important experiments. It dissolves conveniently in polar organic solvents, such as acetonitrile and acetone. With water, its interaction becomes less predictable due to its hydrophobic tail, something which often benefits phase separation tasks or ionic liquid extraction.

Structure and Molecular Formula

Under the microscope or through molecular models, the structure unveils a robust, cationic imidazolium ring substituted with a methyl and a long (hexadecyl) alkyl chain. This arrangement brings both flexibility and rigidity, a rare trait that switches up solubility and support for catalysis or organic synthesis. The hexafluorophosphate anion, PF6-, adds stability and resistance to moisture absorption, in contrast to other anions sometimes prone to hydrolysis.

Specifications, Density, and Forms

Industry standards generally point to high-purity grades (≥98%), a low-moisture content, and the avoidance of volatile impurities. Bulk density shifts depending on particle shape, averaging about 0.5-0.7 g/cm3 as a powder or flake, but increasing in compacted pearl or crystalline forms. In a liter-sized batch, solid flakes or crystals compact well for storage—critical for logistics in chemical warehousing. Form plays a huge part in defining how this ionic liquid is handled, dissolved, or combined with auxiliaries.

Handling, Safety, and Hazards

Many laboratory professionals approach 1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate with the same respect given to most ionic liquids. While not classified as acutely toxic, the presence of hexafluorophosphate raises caution. Prolonged contact with moisture or water can, under harsh conditions, lead to small releases of HF—a serious irritant. Gloves, goggles, and proper ventilation matter not only for personal safety but for the integrity of ongoing experiments. Inhalation or skin contact should be minimized since chronic exposure effects are not fully understood. As a safe practice, storing away from acids, bases, and humid environments goes a long way in preserving shelf life and reducing risks. Disposal through specialized chemical channels prevents environmental contamination, especially given the persistence of fluorinated ion pairs in aquatic systems.

Applications and Industry Relevance

1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate turns useful across various fields. Electrochemical devices, especially those chasing stable electrolyte systems, benefit from the ionic conductivity and thermal stability provided here. Extraction and separation chemists rely on its immiscibility with water and favorable solubility profile in organic solvents. In catalysis, the compound shows remarkable potential as a phase-transfer catalyst, bringing otherwise incompatible substances into contact without aggressive solvents. The cation’s long alkyl chain allows for organized self-assembly on surfaces, which finds use in creating new membranes or facilitating organic reactions under mild conditions.

Global Trade and HS Code

The customs world recognizes this material under its HS Code—designed to streamline identification for imports and exports. While codes can vary depending on jurisdiction, this compound typically falls under “Other Organoinorganic Compounds,” which covers a wide swath of chemicals with both organic and inorganic elements. As ionic liquids gain more ground in industry, tracking and documentation using standard codes ensures proper handling, taxation, and safety compliance. Sourcing from reputable suppliers—who disclose full product specifications and laboratory data—serves users best, reducing the guesswork and uncertain risks tied to poorly documented raw materials.

Personal Experience and Insights

Having worked alongside research teams in academic and industrial settings, curiosity often meets reality once new materials move beyond the catalog and face practical hurdles. During scale-up or process development, even tiny differences in density and particle size can change how something disperses or dissolves. Once, a shipment of 1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate arrived almost waxy—prompting questions about storage temperature and purity control. Small adjustments in storage and dissolving technique restored full performance. This “feel for the material,” guided by data but grounded in real-world handling, helps researchers avoid setbacks that paperwork alone can’t predict. Uncovering dangers—especially moisture-triggered HF risk—led the team to overhaul equipment and improve training, ensuring safer and more reliable processes.

Potential Solutions and Best Practices

To get the most from 1-Hexadecyl-3-Methylimidazolium Hexafluorophosphate while limiting risks, targeted steps help. Storing in airtight, dry containers away from heat and light blocks most premature decomposition. Frequent checks for moisture and visible clumping detect early issues; material should stay free-flowing, not sticky or oily. Providing staff with material safety data sheets and clear handling guidelines—especially for new technicians—protects health and experiment integrity. On the supply side, verifying each batch with supplier documentation and in-house purity testing avoids surprises that could upset production or research timelines. Early collaboration between creative researchers and careful safety professionals yields the best mix of progress and protection, converting potential into practical value for chemists and end users.